N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline

C170H164N10OS — CID 162021926

About N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline

N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline (PubChem CID 162021926) has the molecular formula C170H164N10OS and a molecular weight of 2395.32 g/mol. Its IUPAC name is N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline.

Molecular Properties

• Compound Name: N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline
• PubChem CID: 162021926
• Molecular Formula: C170H164N10OS
• Molecular Weight: 2395.32 g/mol
• Exact Mass: 2393.28
• IUPAC Name: N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline
• SMILES: CC(C)C.CC(C)c1cccc(-c2cccc3cccnc23)c1.CC(C)c1cccc(-c2cccc3ncccc23)c1.CC(C)c1cccc(-c2cccc3nccnc23)c1.CC(C)c1cccc(-c2nc3ccccc3o2)c1.CC(C)c1cccc(-c2nc3ccccc3s2)c1.CC(C)c1cccc(-n2c3ccccc3c3ccccc32)c1.CC(C)c1cccc(C2=Nc3ccccc3C2)c1.CC(C)c1cccc(N(c2ccccc2)c2ccccc2)c1.c1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1
• InChI: InChI=1S/C22H17N.C21H19N.C21H21N.2C18H17N.C17H16N2.C17H17N.C16H15NO.C16H15NS.C4H10/c1-3-12-19(13-4-1)23(20-14-5-2-6-15-20)22-17-9-11-18-10-7-8-16-21(18)22;1-15(2)16-8-7-9-17(14-16)22-20-12-5-3-10-18(20)19-11-4-6-13-21(19)22;1-17(2)18-10-9-15-21(16-18)22(19-11-5-3-6-12-19)20-13-7-4-8-14-20;1-13(2)15-7-3-8-16(12-15)17-10-4-6-14-9-5-11-19-18(14)17;1-13(2)14-6-3-7-15(12-14)16-8-4-10-18-17(16)9-5-11-19-18;1-12(2)13-5-3-6-14(11-13)15-7-4-8-16-17(15)19-10-9-18-16;1-12(2)13-7-5-8-14(10-13)17-11-15-6-3-4-9-16(15)18-17;2*1-11(2)12-6-5-7-13(10-12)16-17-14-8-3-4-9-15(14)18-16;1-4(2)3/h1-17H;3-15H,1-2H3;3-17H,1-2H3;2*3-13H,1-2H3;3-12H,1-2H3;3-10,12H,11H2,1-2H3;2*3-11H,1-2H3;4H,1-3H3
• InChIKey: YUVYJNUBPHBCLJ-UHFFFAOYSA-N
• XLogP: 48.82
• TPSA: 114.25 Ų
• H-Bond Acceptors: 12
• Rotatable Bonds: 21
• Heavy Atoms: 182
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2395.32
LogP ≤ 5	48.82
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	12

Frequently Asked Questions

What is the IUPAC name of N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline?

The IUPAC name of N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline (CID 162021926) is N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline.

What is the SMILES notation for N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline?

The canonical SMILES for N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline is CC(C)C.CC(C)c1cccc(-c2cccc3cccnc23)c1.CC(C)c1cccc(-c2cccc3ncccc23)c1.CC(C)c1cccc(-c2cccc3nccnc23)c1.CC(C)c1cccc(-c2nc3ccccc3o2)c1.CC(C)c1cccc(-c2nc3ccccc3s2)c1.CC(C)c1cccc(-n2c3ccccc3c3ccccc32)c1.CC(C)c1cccc(C2=Nc3ccccc3C2)c1.CC(C)c1cccc(N(c2ccccc2)c2ccccc2)c1.c1ccc(N(c2ccccc2)c2cccc3ccccc23)cc1.

What is the InChIKey of N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline?

The InChIKey is YUVYJNUBPHBCLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N.C21H19N.C21H21N.2C18H17N.C17H16N2.C17H17N.C16H15NO.C16H15NS.C4H10/c1-3-12-19(13-4-1)23(20-14-5-2-6-15-20)22-17-9-11-18-10-7-8-16-21(18)22;1-15(2)16-8-7-9-17(14-16)22-20-12-5-3-10-18(20)19-11-4-6-13-21(19)22;1-17(2)18-10-9-15-21(16-18)22(19-11-5-3-6-12-19)20-13-7-4-8-14-20;1-13(2)15-7-3-8-16(12-15)17-10-4-6-14-9-5-11-19-18(14)17;1-13(2)14-6-3-7-15(12-14)16-8-4-10-18-17(16)9-5-11-19-18;1-12(2)13-5-3-6-14(11-13)15-7-4-8-16-17(15)19-10-9-18-16;1-12(2)13-7-5-8-14(10-13)17-11-15-6-3-4-9-16(15)18-17;2*1-11(2)12-6-5-7-13(10-12)16-17-14-8-3-4-9-15(14)18-16;1-4(2)3/h1-17H;3-15H,1-2H3;3-17H,1-2H3;2*3-13H,1-2H3;3-12H,1-2H3;3-10,12H,11H2,1-2H3;2*3-11H,1-2H3;4H,1-3H3.

What are the key properties of N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline?

N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline has a molecular weight of 2395.32 g/mol, XLogP of 48.82, 21 rotatable bonds, 0 hydrogen bond donors, and 12 hydrogen bond acceptors.

Where does this data come from?

All data for N,N-diphenylnaphthalen-1-amine;N,N-diphenyl-3-propan-2-ylaniline;2-methylpropane;2-(3-propan-2-ylphenyl)-1,3-benzothiazole;2-(3-propan-2-ylphenyl)-1,3-benzoxazole;9-(3-propan-2-ylphenyl)carbazole;2-(3-propan-2-ylphenyl)-3H-indole;5-(3-propan-2-ylphenyl)quinoline;8-(3-propan-2-ylphenyl)quinoline;5-(3-propan-2-ylphenyl)quinoxaline is sourced from PubChem (CID 162021926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).